Tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane

C9H21O2PS3

tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane

CAS13071-79-9
GHS06 Gefahrensymbol: Giftig – Totenkopf mit Knochen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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Identification

CAS Number
13071-79-9
EC Number
235-963-8
UN Number
3018
Index Number
015-139-00-2
PubChem CID
25670

Physical-chemical properties

Molecular Formula
C9H21O2PS3
Molar Mass
288.40 g/mol
IUPAC Name
tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane

Chemical Identifiers

InChI
InChI=1S/C9H21O2PS3/c1-6-10-12(13,11-7-2)15-8-14-9(3,4)5/h6-8H2,1-5H3
InChI Key
XLNZEKHULJKQBA-UHFFFAOYSA-N

Overview

tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane (CAS 13071-79-9) is an organophosphorus compound with highly toxic properties and significant aquatic toxicity concerns. This specialized organophosphorus compound belongs to the lambda5-phosphane family, characterized by its complex molecular structure containing sulfur-phosphorus bonds and ethoxy substituents. With the molecular formula C9H21O2PS3 and a molecular weight of 288.4 g/mol, this technical chemical exhibits distinctive properties that make it valuable for specific industrial applications while requiring stringent safety protocols due to its hazardous classification. The compound carries severe toxicity warnings, classified as Acute Tox. 1 and Acute Tox. 2, indicating extremely dangerous and very dangerous acute toxicity respectively. The GHS06 pictogram reflects its fatal or toxic nature if swallowed, inhaled, or in contact with skin. Additionally, its environmental impact is significant, with Aquatic Acute 1 and Aquatic Chronic 1 classifications accompanied by the GHS09 pictogram, indicating severe toxicity to aquatic life with long-lasting effects. Transportation falls under ADR Class 6.1 for toxic substances, requiring specialized handling and shipping procedures. Despite its hazardous nature, this compound finds applications in advanced chemical synthesis, particularly as an intermediate in organophosphorus chemistry and specialized pharmaceutical manufacturing. Its unique sulfur-phosphorus framework makes it valuable for developing pesticide formulations and complex organic synthesis processes. The compound shares structural similarities with related phosphane derivatives such as diethoxy-(4-methylsulfinylphenoxy)-sulfanylidene-lambda5-phosphane and chloromethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane, which are used in comparable applications. OYSI maintains strict quality standards and regulatory compliance for this highly specialized chemical, ensuring proper documentation and safe distribution to qualified industrial customers across Europe.

Safety & Classification

Danger
Classification:

Acute Tox. 1; Acute Tox. 2 *; Aquatic Acute 1; Aquatic Chronic 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H310

Fatal in contact with skin.

H300

Fatal if swallowed.

H400

Very toxic to aquatic life.

H410

Very toxic to aquatic life with long lasting effects.

Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).

First Aid Measures

Skin Contact

Fatal

Measures if substance contacts the skin

First Aid Actions

  • +P302IF ON SKIN:
  • +P352Wash with plenty of water.
  • +P361Take off immediately all contaminated clothing.
  • +P313Get medical advice/attention.

Related hazard statements:

Ingestion

Fatal

Measures if substance is accidentally swallowed

First Aid Actions

  • +P301IF SWALLOWED:
  • +P330Rinse mouth.
  • +P331Do NOT induce vomiting.
  • +P310Immediately call a POISON CENTER/doctor.

Related hazard statements:

General Measures

Emergency 112 | Poison Control: +49 30 19240 (DE), +33 1 45 42 59 59 (FR), +31 30 274 88 88 (NL)

First aid measures are based on CLP classification and associated P-statements. They do not replace the Safety Data Sheet (SDS). In case of emergency, always consult the full SDS and a physician.

Transport (ADR)

UN Number3018
ADR Class6.1
Packing GroupI
Tunnel CodeC/E
Proper Shipping NameTerbufos (ISO)
Marine PollutantNo

Frequently Asked Questions

What is tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane?

Tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane is an organophosphorus compound with the molecular formula C9H21O2PS3 and CAS number 13071-79-9. This chemical substance has a molecular weight of 288.4 g/mol and contains multiple sulfur atoms in its structure, making it part of the phosphorothioate family. It is classified as highly hazardous with acute toxicity properties and environmental risks, requiring careful handling and specialized safety measures in industrial applications.

What are the physicochemical properties of tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane?

Tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane is an organophosphorus compound with a molecular weight of 288.4 g/mol and the formula C9H21O2PS3. The substance contains multiple sulfur functionalities and ethoxy groups attached to a phosphorus center. As a lambda5-phosphane derivative, it exhibits specific reactivity patterns typical of pentavalent phosphorus compounds. Detailed physical properties such as melting point, boiling point, and solubility data require consultation of technical datasheets for specific applications.

What is tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane used for?

Tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane is primarily used as a specialized chemical intermediate in organic synthesis and research applications. Its unique phosphorus-sulfur framework makes it valuable for developing organophosphorus compounds, potential pesticide formulations, or pharmaceutical intermediates. The compound's specific structure suggests applications in materials science or as a reagent in specialized chemical transformations. However, its high toxicity classification limits its use to professional and industrial settings with appropriate safety infrastructure and expertise.

How to handle tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane safely?

Tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane requires maximum safety precautions due to its Acute Toxicity Category 1 classification. Essential personal protective equipment includes full-face respirators, chemical-resistant gloves, and complete body protection suits. Work must be conducted in well-ventilated areas or under fume hoods with emergency shower and eyewash stations nearby. Only trained personnel should handle this substance, following strict protocols for highly toxic materials and maintaining emergency response procedures for potential exposure incidents.

How to store tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane correctly?

Tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane must be stored in a secure, temperature-controlled environment away from incompatible materials. Storage areas should be well-ventilated, fireproof, and equipped with spill containment systems. The substance requires separation from oxidizing agents, acids, and bases due to potential reactive hazards. Access should be restricted to authorized personnel only, with clear labeling indicating the high toxicity classification. Emergency response equipment and safety data sheets must be readily available in the storage vicinity.

What to do in case of contact with tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane?

Immediate medical attention is required for any contact with tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane due to its extreme toxicity. For skin contact, remove contaminated clothing and flush affected areas with copious amounts of water for at least 15 minutes. In case of eye contact, irrigate continuously with clean water and seek emergency medical care. If inhaled, move the person to fresh air immediately and provide respiratory support if needed. Never induce vomiting if ingested, and contact poison control centers or emergency medical services immediately.

How to dispose of tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane appropriately?

Tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane requires disposal as hazardous waste through licensed waste management companies. The substance cannot be disposed of through normal waste streams due to its high toxicity and environmental hazard classification. Disposal must comply with local and European waste regulations, including proper documentation and tracking. Incineration at high temperatures in specialized facilities is typically required, with appropriate emission controls for sulfur and phosphorus compounds. Consult local environmental authorities for specific disposal requirements and authorized waste handlers.

How to transport tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane?

Tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane is classified under ADR Class 6.1 (Toxic substances) Packing Group I, indicating maximum transport restrictions. Transportation requires specialized packaging meeting UN standards, proper hazard labeling with GHS06 and GHS09 pictograms, and documentation including safety data sheets. Only certified carriers with training in hazardous materials can transport this substance. Emergency response information must accompany shipments, and routing should avoid populated areas when possible. Air transport may have additional restrictions due to the high toxicity classification.

Is tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane subject to special regulations?

Tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane is subject to comprehensive European chemical regulations including REACH registration requirements and CLP classification obligations. The substance is not currently listed as an SVHC (Substance of Very High Concern), but its Acute Toxicity 1 classification imposes strict handling, labeling, and safety data sheet requirements. Users must comply with occupational exposure limits, environmental discharge restrictions, and worker protection regulations. Import, manufacture, and use may require specific authorizations or notifications to regulatory authorities depending on quantities and applications.

Where to buy tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane in Europe?

Tert-butylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane is available through OYSI, a specialized European distributor of technical chemicals with expertise in hazardous materials. OYSI provides proper packaging, documentation, and regulatory compliance support for this highly toxic substance. Due to its extreme hazard classification, purchase is typically restricted to qualified industrial users, research institutions, and companies with appropriate safety infrastructure. Buyers must demonstrate proper handling capabilities, storage facilities, and waste disposal arrangements before procurement can be approved through authorized chemical suppliers.

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Data Sources

Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.